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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50529330   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Endoplasmic reticulum aminopeptidase 2


(Homo sapiens (Human))
BDBM50529330
PNG
(CHEMBL4527760)
Show SMILES CCCC[C@H](N)C(=O)NNc1ccc(cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C31H35N5O4/c1-2-3-12-26(32)30(38)36-35-24-16-14-22(15-17-24)29(37)34-28(31(39)40-20-21-9-5-4-6-10-21)18-23-19-33-27-13-8-7-11-25(23)27/h4-11,13-17,19,26,28,33,35H,2-3,12,18,20,32H2,1H3,(H,34,37)(H,36,38)/t26-,28-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



National Centre for Scientific Research "Demokritos"

Curated by ChEMBL


Assay Description
Competitive inhibition of human recombinant ERAP2 expressed in baculovirus infected sf9 cells using R-AMC as substrate incubated for 5 to 10 mins by ...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115177
BindingDB Entry DOI: 10.7270/Q2FN19NT
More data for this
Ligand-Target Pair
Interleukin-1 receptor antagonist protein


(Homo sapiens)
BDBM50529330
PNG
(CHEMBL4527760)
Show SMILES CCCC[C@H](N)C(=O)NNc1ccc(cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C31H35N5O4/c1-2-3-12-26(32)30(38)36-35-24-16-14-22(15-17-24)29(37)34-28(31(39)40-20-21-9-5-4-6-10-21)18-23-19-33-27-13-8-7-11-25(23)27/h4-11,13-17,19,26,28,33,35H,2-3,12,18,20,32H2,1H3,(H,34,37)(H,36,38)/t26-,28-/m0/s1
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1.30E+3n/an/an/an/an/an/an/an/a



National Centre for Scientific Research "Demokritos"

Curated by ChEMBL


Assay Description
Competitive inhibition of human recombinant IRAP expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by M...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115177
BindingDB Entry DOI: 10.7270/Q2FN19NT
More data for this
Ligand-Target Pair
Endoplasmic reticulum aminopeptidase 1


(Homo sapiens (Human))
BDBM50529330
PNG
(CHEMBL4527760)
Show SMILES CCCC[C@H](N)C(=O)NNc1ccc(cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C31H35N5O4/c1-2-3-12-26(32)30(38)36-35-24-16-14-22(15-17-24)29(37)34-28(31(39)40-20-21-9-5-4-6-10-21)18-23-19-33-27-13-8-7-11-25(23)27/h4-11,13-17,19,26,28,33,35H,2-3,12,18,20,32H2,1H3,(H,34,37)(H,36,38)/t26-,28-/m0/s1
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Article
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1.09E+4n/an/an/an/an/an/an/an/a



National Centre for Scientific Research "Demokritos"

Curated by ChEMBL


Assay Description
Competitive inhibition of human recombinant ERAP1 expressed in baculovirus infected sf9 cells using L-AMC as substrate incubated for 5 to 10 mins by ...


Bioorg Med Chem 27: (2019)


Article DOI: 10.1016/j.bmc.2019.115177
BindingDB Entry DOI: 10.7270/Q2FN19NT
More data for this
Ligand-Target Pair